1-[methylsulfonyl-[2-[2-oxidanylidene-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]phenyl]carbonyl-amino]urea

Systemtic Name: 1-[methylsulfonyl-[2-[2-oxidanylidene-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]phenyl]carbonyl-amino]urea Openeye Name: [methylsulfonyl-[2-[2-oxo-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]benzoyl]amino]urea CAS Name: [methylsulfonyl-[oxo-[2-[2-oxo-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-5-phenyl-3H-1,4-benzodiazepin-3-yl]phenyl]methyl]amino]urea IUPAC Name: [methylsulfonyl-[2-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]benzoyl]amino]urea Traditional Name: [[2-[2-keto-1-(2-keto-2-pyrrolidino-ethyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]benzoyl]-mesyl-amino]urea Formula: C30H30N6O6S MolecularWeight: 602.6608

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(C(=O)C1=CC=CC=C1C2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CC(=O)N5CCCC5)NC(=O)N

Isomeric SMILES

CS(=O)(=O)N(C(=O)C1=CC=CC=C1C2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CC(=O)N5CCCC5)NC(=O)N

InChI

InChI=1S/C30H30N6O6S/c1-43(41,42)36(33-30(31)40)28(38)22-14-6-5-13-21(22)27-29(39)35(19-25(37)34-17-9-10-18-34)24-16-8-7-15-23(24)26(32-27)20-11-3-2-4-12-20/h2-8,11-16,27H,9-10,17-19H2,1H3,(H3,31,33,40)