3-butyl-1-methyl-1-[(E)-(4-pyrrolidin-1-ylphenyl)methylideneamino]thiourea

Systemtic Name: 3-butyl-1-methyl-1-[(E)-(4-pyrrolidin-1-ylphenyl)methylideneamino]thiourea Openeye Name: 3-butyl-1-methyl-1-[(E)-(4-pyrrolidin-1-ylphenyl)methyleneamino]thiourea CAS Name: 3-butyl-1-methyl-1-[(E)-[4-(1-pyrrolidinyl)phenyl]methylideneamino]thiourea IUPAC Name: 3-butyl-1-methyl-1-[(E)-(4-pyrrolidin-1-ylphenyl)methylideneamino]thiourea Traditional Name: 3-butyl-1-methyl-1-[(E)-(4-pyrrolidinobenzylidene)amino]thiourea Formula: C17H26N4S MolecularWeight: 318.48014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(C)N=CC1=CC=C(C=C1)N2CCCC2

Isomeric SMILES

CCCCNC(=S)N(C)/N=C/C1=CC=C(C=C1)N2CCCC2

InChI

InChI=1S/C17H26N4S/c1-3-4-11-18-17(22)20(2)19-14-15-7-9-16(10-8-15)21-12-5-6-13-21/h7-10,14H,3-6,11-13H2,1-2H3,(H,18,22)/b19-14+