N-[2-[[3,6-bis(chloranyl)-1-benzothiophen-2-yl]carbonylamino]ethyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[2-[[3,6-bis(chloranyl)-1-benzothiophen-2-yl]carbonylamino]ethyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[2-[(3,6-dichlorobenzothiophene-2-carbonyl)amino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[2-[[(3,6-dichloro-1-benzothiophen-2-yl)-oxomethyl]amino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[2-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[2-[(3,6-dichlorobenzothiophene-2-carbonyl)amino]ethyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C20H14Cl2N4O3S MolecularWeight: 461.32116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=O)NCCNC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=O)NCCNC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H14Cl2N4O3S/c21-10-5-6-12-14(9-10)30-16(15(12)22)19(28)23-7-8-24-20(29)17-25-13-4-2-1-3-11(13)18(27)26-17/h1-6,9H,7-8H2,(H,23,28)(H,24,29)(H,25,26,27)