[1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]benzimidazol-5-yl]-pyrrolidin-1-yl-methanethione

Systemtic Name: [1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]benzimidazol-5-yl]-pyrrolidin-1-yl-methanethione Openeye Name: [1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]benzimidazol-5-yl]-pyrrolidin-1-yl-methanethione CAS Name: [1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]-5-benzimidazolyl]-(1-pyrrolidinyl)methanethione IUPAC Name: [1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]benzimidazol-5-yl]-pyrrolidin-1-ylmethanethione Traditional Name: [1-(cyclopropylmethyl)-2-(4-ethoxybenzyl)benzimidazol-5-yl]-pyrrolidino-methanethione Formula: C25H29N3OS MolecularWeight: 419.58226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=NC3=C(N2CC4CC4)C=CC(=C3)C(=S)N5CCCC5

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=NC3=C(N2CC4CC4)C=CC(=C3)C(=S)N5CCCC5

InChI

InChI=1S/C25H29N3OS/c1-2-29-21-10-7-18(8-11-21)15-24-26-22-16-20(25(30)27-13-3-4-14-27)9-12-23(22)28(24)17-19-5-6-19/h7-12,16,19H,2-6,13-15,17H2,1H3