(3S)-N-(3,4-dimethoxyphenyl)-1-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]piperidin-3-amine

Systemtic Name: (3S)-N-(3,4-dimethoxyphenyl)-1-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]piperidin-3-amine Openeye Name: (3S)-N-(3,4-dimethoxyphenyl)-1-[(2-pyrrolidin-1-ylthiazol-5-yl)methyl]piperidin-3-amine CAS Name: (3S)-N-(3,4-dimethoxyphenyl)-1-[[2-(1-pyrrolidinyl)-5-thiazolyl]methyl]-3-piperidinamine IUPAC Name: (3S)-N-(3,4-dimethoxyphenyl)-1-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]piperidin-3-amine Traditional Name: (3,4-dimethoxyphenyl)-[(3S)-1-[(2-pyrrolidinothiazol-5-yl)methyl]-3-piperidyl]amine Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2CCCN(C2)CC3=CN=C(S3)N4CCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N[C@H]2CCCN(C2)CC3=CN=C(S3)N4CCCC4)OC

InChI

InChI=1S/C21H30N4O2S/c1-26-19-8-7-16(12-20(19)27-2)23-17-6-5-9-24(14-17)15-18-13-22-21(28-18)25-10-3-4-11-25/h7-8,12-13,17,23H,3-6,9-11,14-15H2,1-2H3/t17-/m0/s1