1-(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-(cyclopropylmethyl)piperazine

Systemtic Name: 1-(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-(cyclopropylmethyl)piperazine Openeye Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-(cyclopropylmethyl)piperazine CAS Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-(cyclopropylmethyl)piperazine IUPAC Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-(cyclopropylmethyl)piperazine Traditional Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-(cyclopropylmethyl)piperazine Formula: C22H25ClN2S MolecularWeight: 384.9653

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2CCN(CC2)C3CC4=CC=CC=C4SC5=C3C=C(C=C5)Cl

Isomeric SMILES

C1CC1CN2CCN(CC2)C3CC4=CC=CC=C4SC5=C3C=C(C=C5)Cl

InChI

InChI=1S/C22H25ClN2S/c23-18-7-8-22-19(14-18)20(13-17-3-1-2-4-21(17)26-22)25-11-9-24(10-12-25)15-16-5-6-16/h1-4,7-8,14,16,20H,5-6,9-13,15H2