1-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]-3-(4-phenoxyphenyl)-2-(2-pyrrolidin-1-ylethyl)guanidine

Systemtic Name: 1-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]-3-(4-phenoxyphenyl)-2-(2-pyrrolidin-1-ylethyl)guanidine Openeye Name: 1-[2-(4-methylthiazol-5-yl)ethyl]-3-(4-phenoxyphenyl)-2-(2-pyrrolidin-1-ylethyl)guanidine CAS Name: 1-[2-(4-methyl-5-thiazolyl)ethyl]-3-(4-phenoxyphenyl)-2-[2-(1-pyrrolidinyl)ethyl]guanidine IUPAC Name: 1-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]-3-(4-phenoxyphenyl)-2-(2-pyrrolidin-1-ylethyl)guanidine Traditional Name: 1-[2-(4-methylthiazol-5-yl)ethyl]-3-(4-phenoxyphenyl)-2-(2-pyrrolidinoethyl)guanidine Formula: C25H31N5OS MolecularWeight: 449.61154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=N1)CCNC(=NCCN2CCCC2)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC=N1)CCNC(=NCCN2CCCC2)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H31N5OS/c1-20-24(32-19-28-20)13-14-26-25(27-15-18-30-16-5-6-17-30)29-21-9-11-23(12-10-21)31-22-7-3-2-4-8-22/h2-4,7-12,19H,5-6,13-18H2,1H3,(H2,26,27,29)