1-[4-(5-chloranyl-1H-indol-3-yl)-5-methyl-1,3-thiazol-2-yl]-2-(phenylmethyl)guanidine

Systemtic Name: 1-[4-(5-chloranyl-1H-indol-3-yl)-5-methyl-1,3-thiazol-2-yl]-2-(phenylmethyl)guanidine Openeye Name: 2-benzyl-1-[4-(5-chloro-1H-indol-3-yl)-5-methyl-thiazol-2-yl]guanidine CAS Name: 1-[4-(5-chloro-1H-indol-3-yl)-5-methyl-2-thiazolyl]-2-(phenylmethyl)guanidine IUPAC Name: 2-benzyl-1-[4-(5-chloro-1H-indol-3-yl)-5-methyl-1,3-thiazol-2-yl]guanidine Traditional Name: 2-benzyl-1-[4-(5-chloro-1H-indol-3-yl)-5-methyl-thiazol-2-yl]guanidine Formula: C20H18ClN5S MolecularWeight: 395.90842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=NCC2=CC=CC=C2)N)C3=CNC4=C3C=C(C=C4)Cl

Isomeric SMILES

CC1=C(N=C(S1)NC(=NCC2=CC=CC=C2)N)C3=CNC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C20H18ClN5S/c1-12-18(16-11-23-17-8-7-14(21)9-15(16)17)25-20(27-12)26-19(22)24-10-13-5-3-2-4-6-13/h2-9,11,23H,10H2,1H3,(H3,22,24,25,26)