N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-3-(1-propyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide

Systemtic Name: N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-3-(1-propyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide Openeye Name: N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-3-(1-propyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide CAS Name: N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-3-[1-propyl-5-(1-pyrrolidinylsulfonyl)-2-benzimidazolyl]propanamide IUPAC Name: N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-3-(1-propyl-5-pyrrolidin-1-ylsulfonylbenzimidazol-2-yl)propanamide Traditional Name: N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-3-(1-propyl-5-pyrrolidinosulfonyl-benzimidazol-2-yl)propionamide Formula: C21H29N7O3S MolecularWeight: 459.56506

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)NCC4=NN=CN4C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)NCC4=NN=CN4C

InChI

InChI=1S/C21H29N7O3S/c1-3-10-28-18-7-6-16(32(30,31)27-11-4-5-12-27)13-17(18)24-19(28)8-9-21(29)22-14-20-25-23-15-26(20)2/h6-7,13,15H,3-5,8-12,14H2,1-2H3,(H,22,29)