4-[[5-[(4-butylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]butanenitrile

Systemtic Name: 4-[[5-[(4-butylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]butanenitrile Openeye Name: 4-[[5-(4-butylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanenitrile CAS Name: 4-[[5-(4-butylanilino)-1,3,4-thiadiazol-2-yl]thio]butanenitrile IUPAC Name: 4-[[5-(4-butylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanenitrile Traditional Name: 4-[[5-(4-butylanilino)-1,3,4-thiadiazol-2-yl]thio]butyronitrile Formula: C16H20N4S2 MolecularWeight: 332.4868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NN=C(S2)SCCCC#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NN=C(S2)SCCCC#N

InChI

InChI=1S/C16H20N4S2/c1-2-3-6-13-7-9-14(10-8-13)18-15-19-20-16(22-15)21-12-5-4-11-17/h7-10H,2-6,12H2,1H3,(H,18,19)