N-[3-[[4-(4-butylphenyl)-1,3-thiazol-2-yl]amino]-3-oxidanylidene-propyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[[4-(4-butylphenyl)-1,3-thiazol-2-yl]amino]-3-oxidanylidene-propyl]thiophene-2-carboxamide Openeye Name: N-[3-[[4-(4-butylphenyl)thiazol-2-yl]amino]-3-oxo-propyl]thiophene-2-carboxamide CAS Name: N-[3-[[4-(4-butylphenyl)-2-thiazolyl]amino]-3-oxopropyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[[4-(4-butylphenyl)-1,3-thiazol-2-yl]amino]-3-oxopropyl]thiophene-2-carboxamide Traditional Name: N-[3-[[4-(4-butylphenyl)thiazol-2-yl]amino]-3-keto-propyl]thiophene-2-carboxamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCNC(=O)C3=CC=CS3

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCNC(=O)C3=CC=CS3

InChI

InChI=1S/C21H23N3O2S2/c1-2-3-5-15-7-9-16(10-8-15)17-14-28-21(23-17)24-19(25)11-12-22-20(26)18-6-4-13-27-18/h4,6-10,13-14H,2-3,5,11-12H2,1H3,(H,22,26)(H,23,24,25)