N-[4-[[(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)carbonylamino]carbamoyl]phenyl]butanamide

Systemtic Name: N-[4-[[(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)carbonylamino]carbamoyl]phenyl]butanamide Openeye Name: N-[4-[[(3-chloro-6-methoxy-benzothiophene-2-carbonyl)amino]carbamoyl]phenyl]butanamide CAS Name: N-[4-[[[(3-chloro-6-methoxy-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-oxomethyl]phenyl]butanamide IUPAC Name: N-[4-[[(3-chloro-6-methoxy-1-benzothiophene-2-carbonyl)amino]carbamoyl]phenyl]butanamide Traditional Name: N-[4-[[(3-chloro-6-methoxy-benzothiophene-2-carbonyl)amino]carbamoyl]phenyl]butyramide Formula: C21H20ClN3O4S MolecularWeight: 445.9192

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)OC)Cl

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)OC)Cl

InChI

InChI=1S/C21H20ClN3O4S/c1-3-4-17(26)23-13-7-5-12(6-8-13)20(27)24-25-21(28)19-18(22)15-10-9-14(29-2)11-16(15)30-19/h5-11H,3-4H2,1-2H3,(H,23,26)(H,24,27)(H,25,28)