[1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]benzimidazol-5-yl]-[4-[3-(dimethylamino)propyl]piperazin-1-yl]methanethione

Systemtic Name: [1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]benzimidazol-5-yl]-[4-[3-(dimethylamino)propyl]piperazin-1-yl]methanethione Openeye Name: [1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]benzimidazol-5-yl]-[4-[3-(dimethylamino)propyl]piperazin-1-yl]methanethione CAS Name: [1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]-5-benzimidazolyl]-[4-[3-(dimethylamino)propyl]-1-piperazinyl]methanethione IUPAC Name: [1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]benzimidazol-5-yl]-[4-[3-(dimethylamino)propyl]piperazin-1-yl]methanethione Traditional Name: [1-(cyclopropylmethyl)-2-(4-ethoxybenzyl)benzimidazol-5-yl]-[4-[3-(dimethylamino)propyl]piperazino]methanethione Formula: C30H41N5OS MolecularWeight: 519.74444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=NC3=C(N2CC4CC4)C=CC(=C3)C(=S)N5CCN(CC5)CCCN(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=NC3=C(N2CC4CC4)C=CC(=C3)C(=S)N5CCN(CC5)CCCN(C)C

InChI

InChI=1S/C30H41N5OS/c1-4-36-26-11-8-23(9-12-26)20-29-31-27-21-25(10-13-28(27)35(29)22-24-6-7-24)30(37)34-18-16-33(17-19-34)15-5-14-32(2)3/h8-13,21,24H,4-7,14-20,22H2,1-3H3