N-[5-(4-methylpiperazin-1-yl)-2-oxidanylidene-1-propyl-3H-1,4-benzodiazepin-3-yl]propanamide

Systemtic Name: N-[5-(4-methylpiperazin-1-yl)-2-oxidanylidene-1-propyl-3H-1,4-benzodiazepin-3-yl]propanamide Openeye Name: N-[5-(4-methylpiperazin-1-yl)-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl]propanamide CAS Name: N-[5-(4-methyl-1-piperazinyl)-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl]propanamide IUPAC Name: N-[5-(4-methylpiperazin-1-yl)-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl]propanamide Traditional Name: N-[2-keto-5-(4-methylpiperazino)-1-propyl-3H-1,4-benzodiazepin-3-yl]propionamide Formula: C20H29N5O2 MolecularWeight: 371.47656

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CC)N3CCN(CC3)C

Isomeric SMILES

CCCN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CC)N3CCN(CC3)C

InChI

InChI=1S/C20H29N5O2/c1-4-10-25-16-9-7-6-8-15(16)19(24-13-11-23(3)12-14-24)22-18(20(25)27)21-17(26)5-2/h6-9,18H,4-5,10-14H2,1-3H3,(H,21,26)