3-cyano-2-phenyl-1-propyl-1-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)guanidine

Systemtic Name: 3-cyano-2-phenyl-1-propyl-1-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)guanidine Openeye Name: 3-cyano-2-phenyl-1-propyl-1-(2-thioxo-3H-1,3-benzothiazol-6-yl)guanidine CAS Name: 3-cyano-2-phenyl-1-propyl-1-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)guanidine IUPAC Name: 3-cyano-2-phenyl-1-propyl-1-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)guanidine Traditional Name: 3-cyano-2-phenyl-1-propyl-1-(2-thioxo-3H-1,3-benzothiazol-6-yl)guanidine Formula: C18H17N5S2 MolecularWeight: 367.49108

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC2=C(C=C1)NC(=S)S2)C(=NC3=CC=CC=C3)NC#N

Isomeric SMILES

CCCN(C1=CC2=C(C=C1)NC(=S)S2)C(=NC3=CC=CC=C3)NC#N

InChI

InChI=1S/C18H17N5S2/c1-2-10-23(14-8-9-15-16(11-14)25-18(24)22-15)17(20-12-19)21-13-6-4-3-5-7-13/h3-9,11H,2,10H2,1H3,(H,20,21)(H,22,24)